6-Aminopyrimidine-4-carbonitrile - CAS 1353100-84-1

Catalog:	BB054988
Product Name:	6-Aminopyrimidine-4-carbonitrile
CAS:	1353100-84-1
Synonyms:	6-aminopyrimidine-4-carbonitrile; 4-Amino-6-cyanopyrimidine

Technical Data

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Computed Properties

IUPAC Name:	6-aminopyrimidine-4-carbonitrile
Molecular Weight:	120.11
Molecular Formula:	C5H4N4
Canonical SMILES:	C1=C(N=CN=C1N)C#N
InChI:	InChI=1S/C5H4N4/c6-2-4-1-5(7)9-3-8-4/h1,3H,(H2,7,8,9)
InChI Key:	XEZTUEAUBMEYBJ-UHFFFAOYSA-N

Publication Number	Title	Priority Date
US-2021094921-A1	Inhibitors of receptor interacting protein kinase i for the treatment of disease	20190927
WO-2021062199-A1	Inhibitors of receptor interacting protein kinase i for the treatment of disease	20190927
AU-2017342464-A1	TYK2 inhibitors and uses thereof	20161014
CA-3039202-A1	Tyk2 inhibitors and uses thereof	20161014
CN-109952303-A	TYK2 inhibitor and application thereof	20161014
EP-3526222-A1	Tyk2 inhibitors and uses thereof	20161014
JP-2019535807-A	TYK2 inhibitors and uses thereof	20161014
TW-201823243-A	TYK2 inhibitor and its use	20161014
US-10323036-B2	TYK2 inhibitors and uses thereof	20161014
US-2018155349-A1	Tyk2 inhibitors and uses thereof	20161014

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	135
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	120.043596145
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	120.043596145
Rotatable Bond Count:	0
Topological Polar Surface Area:	75.6Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.1